dimethyl 2-[1-(3-ethoxyphenyl)carbonyl-6-fluoranyl-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[1-(3-ethoxyphenyl)carbonyl-6-fluoranyl-2,2-dimethyl-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[1-(3-ethoxybenzoyl)-6-fluoro-2,2-dimethyl-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[1-[(3-ethoxyphenyl)-oxomethyl]-6-fluoro-2,2-dimethyl-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[1-(3-ethoxybenzoyl)-6-fluoro-2,2-dimethyl-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[1-(3-ethoxybenzoyl)-6-fluoro-2,2-dimethyl-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C27H24FNO6S3 MolecularWeight: 573.675963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)N2C3=C(C=C(C=C3)F)C(=C4SC(=C(S4)C(=O)OC)C(=O)OC)C(=S)C2(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)N2C3=C(C=C(C=C3)F)C(=C4SC(=C(S4)C(=O)OC)C(=O)OC)C(=S)C2(C)C

InChI

InChI=1S/C27H24FNO6S3/c1-6-35-16-9-7-8-14(12-16)23(30)29-18-11-10-15(28)13-17(18)19(22(36)27(29,2)3)26-37-20(24(31)33-4)21(38-26)25(32)34-5/h7-13H,6H2,1-5H3